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2-ethoxy-5-[4-(hydroxymethyl)piperazin-1-yl]sulfonyl-benzoic acid

2-ethoxy-5-[4-(hydroxymethyl)piperazin-1-yl]sulfonyl-benzoic acid

Systemtic Name:2-ethoxy-5-[4-(hydroxymethyl)piperazin-1-yl]sulfonyl-benzoic acid
Openeye Name:2-ethoxy-5-[4-(hydroxymethyl)piperazin-1-yl]sulfonyl-benzoic acid
CAS Name:2-ethoxy-5-[[4-(hydroxymethyl)-1-piperazinyl]sulfonyl]benzoic acid
IUPAC Name:2-ethoxy-5-[4-(hydroxymethyl)piperazin-1-yl]sulfonylbenzoic acid
Traditional Name:2-ethoxy-5-(4-methylolpiperazino)sulfonyl-benzoic acid
Formula: C14H20N2O6S
MolecularWeight: 344.3834
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CO)C(=O)O


Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CO)C(=O)O


InChI

InChI=1S/C14H20N2O6S/c1-2-22-13-4-3-11(9-12(13)14(18)19)23(20,21)16-7-5-15(10-17)6-8-16/h3-4,9,17H,2,5-8,10H2,1H3,(H,18,19)


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